CAS 122-95-2 | Benzene, 1,4-diethoxy- | CAS Number 122-95-2

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122-95-2 | Benzene, 1,4-diethoxy-

CAS No: 122-95-2 Catalog No: AG0016JP MDL No:MFCD00015146

Product Description

Catalog Number:

AG0016JP

Chemical Name:

Benzene, 1,4-diethoxy-

CAS Number:

122-95-2

Molecular Formula:

C10H14O2

Molecular Weight:

166.2170

MDL Number:

MFCD00015146

IUPAC Name:

1,4-diethoxybenzene

InChI:

InChI=1S/C10H14O2/c1-3-11-9-5-7-10(8-6-9)12-4-2/h5-8H,3-4H2,1-2H3

InChI Key:

VWGNFIQXBYRDCH-UHFFFAOYSA-N

SMILES:

CCOc1ccc(cc1)OCC

EC Number:

204-585-5

UNII:

C6Y51501JB

Properties

Complexity:

92.4

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

166.099g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

166.22g/mol

Monoisotopic Mass:

166.099g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

18.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5

Literature

Title	Journal
Degradation of various alkyl ethers by alkyl ether-degrading Actinobacteria isolated from activated sludge of a mixed wastewater treatment.	Chemosphere 20081101
Screening of dialkoxybenzenes and disubstituted cyclopentene derivatives against the cabbage looper, Trichoplusia ni, for the discovery of new feeding and oviposition deterrents.	Journal of agricultural and food chemistry 20071212
Physiological, numerical and molecular characterization of alkyl ether-utilizing rhodococci.	Environmental microbiology 20070601
In silico identification and biochemical characterization of novel inhibitors of NQO1.	Bioorganic & medicinal chemistry letters 20061215